phenacyl 4-[[4-oxidanylidene-4-(2-oxidanylidene-2-thiophen-2-yl-ethoxy)butanoyl]amino]benzoate

Systemtic Name: phenacyl 4-[[4-oxidanylidene-4-(2-oxidanylidene-2-thiophen-2-yl-ethoxy)butanoyl]amino]benzoate Openeye Name: phenacyl 4-[[4-oxo-4-[2-oxo-2-(2-thienyl)ethoxy]butanoyl]amino]benzoate CAS Name: 4-[[1,4-dioxo-4-(2-oxo-2-thiophen-2-ylethoxy)butyl]amino]benzoic acid phenacyl ester IUPAC Name: phenacyl 4-[[4-oxo-4-(2-oxo-2-thiophen-2-ylethoxy)butanoyl]amino]benzoate Traditional Name: 4-[[4-keto-4-[2-keto-2-(2-thienyl)ethoxy]butanoyl]amino]benzoic acid phenacyl ester Formula: C25H21NO7S MolecularWeight: 479.50174

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)NC(=O)CCC(=O)OCC(=O)C3=CC=CS3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)NC(=O)CCC(=O)OCC(=O)C3=CC=CS3

InChI

InChI=1S/C25H21NO7S/c27-20(17-5-2-1-3-6-17)15-33-25(31)18-8-10-19(11-9-18)26-23(29)12-13-24(30)32-16-21(28)22-7-4-14-34-22/h1-11,14H,12-13,15-16H2,(H,26,29)